input word = C00021896

Metabolite InformationStructural formula
Name 4-Oxogymnomitryl acetate
Formula C17H24O3
Mw 276.17254463
CAS RN 117005-49-9
C_ID C00021896 ,
InChIKey FPJFCLWCESSDLX-NLCSWOTRNA-N
InChICode InChI=1S/C17H24O3/c1-10-12(19)9-16(4)14(20-11(2)18)13(10)15(3)7-6-8-17(15,16)5/h13-14H,1,6-9H2,2-5H3/t13-,14-,15-,16+,17-/m0/s1
SMILES C1(=O)C[C@]2([C@@]3([C@]([C@@H](C1=C)[C@@H]2OC(=O)C)(CCC3)C)C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaePlagiochilaceaePlagiochila trabeculata Ref.
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